(4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[3-[(1R)-1-phenylethyl]imidazol-4-yl]methanone

C23H24N4O — CID 155669602

IUPAC(4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[3-[(1R)-1-phenylethyl]imidazol-4-yl]methanone
SMILESC[C@H](c1ccccc1)n1cncc1C(=O)N1CCN(C2CC2)c2ccccc21
InChIInChI=1S/C23H24N4O/c1-17(18-7-3-2-4-8-18)27-16-24-15-22(27)23(28)26-14-13-25(19-11-12-19)20-9-5-6-10-21(20)26/h2-10,15-17,19H,11-14H2,1H3/t17-/m1/s1
InChIKeyLRVQGFKSRFYBMY-QGZVFWFLSA-N
MW372.47 g/mol
LogP4.12
Rot. Bonds4

About (4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[3-[(1R)-1-phenylethyl]imidazol-4-yl]methanone

(4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[3-[(1R)-1-phenylethyl]imidazol-4-yl]methanone (PubChem CID 155669602) has the molecular formula C23H24N4O and a molecular weight of 372.47 g/mol. Its IUPAC name is (4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[3-[(1R)-1-phenylethyl]imidazol-4-yl]methanone.

Molecular Properties

Compound Name(4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[3-[(1R)-1-phenylethyl]imidazol-4-yl]methanone
PubChem CID155669602
Molecular FormulaC23H24N4O
Molecular Weight372.47 g/mol
Exact Mass372.20
IUPAC Name(4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[3-[(1R)-1-phenylethyl]imidazol-4-yl]methanone
SMILESC[C@H](c1ccccc1)n1cncc1C(=O)N1CCN(C2CC2)c2ccccc21
InChIInChI=1S/C23H24N4O/c1-17(18-7-3-2-4-8-18)27-16-24-15-22(27)23(28)26-14-13-25(19-11-12-19)20-9-5-6-10-21(20)26/h2-10,15-17,19H,11-14H2,1H3/t17-/m1/s1
InChIKeyLRVQGFKSRFYBMY-QGZVFWFLSA-N
XLogP4.12
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[3-[(1R)-1-phenylethyl]imidazol-4-yl]methanone with MolForge

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Related Compounds

9-[4-(decahydroquinolin-1-yl)butyl]-2-(phenylamino)-6,9-dihydro-3H-purin-6-one dihydrochloride
CID 135514465
2-anilino-9-[4-(2-phenyl-1-piperidyl)butyl]-1H-purin-6-one
CID 135514486
2-anilino-9-[4-(3,4-dihydro-2H-quinolin-1-yl)butyl]-1H-purin-6-one
CID 135518344
(1-Benzyl-1h-Imidazol-4-Yl)[4-(2-Chlorophenyl)piperazin-1-Yl]methanone
CID 74983356
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-3-(1-methylethyl)-5-phenyl-
CID 3071940
1-(2-tert-Butylphenyl)-4-(1H-imidazol-4-ylcarbonyl)piperazine
CID 66751133
N-(2-fluoro-5-methylphenyl)-3-phenylimidazole-4-carboxamide
CID 8002584
7-benzyl-8-(1H-imidazol-1-yl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
CID 797199
2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(phenylmethyl)-N-(2-pyridinyl)acetamide
CID 648426
3-[3-(Trifluoromethyl)phenyl]-5-isopropylimidazo[1,5-a]quinoxaline-4(5H)-one
CID 10523240
3-Phenyl-5-propan-2-ylimidazo[1,5-a]quinoxalin-4-one
CID 10542471
N,N-dimethyl-3-phenyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide
CID 10615510

Frequently Asked Questions

What is the IUPAC name of (4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[3-[(1R)-1-phenylethyl]imidazol-4-yl]methanone?
The IUPAC name of (4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[3-[(1R)-1-phenylethyl]imidazol-4-yl]methanone (CID 155669602) is (4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[3-[(1R)-1-phenylethyl]imidazol-4-yl]methanone.
What is the SMILES notation for (4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[3-[(1R)-1-phenylethyl]imidazol-4-yl]methanone?
The canonical SMILES for (4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[3-[(1R)-1-phenylethyl]imidazol-4-yl]methanone is C[C@H](c1ccccc1)n1cncc1C(=O)N1CCN(C2CC2)c2ccccc21.
What is the InChIKey of (4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[3-[(1R)-1-phenylethyl]imidazol-4-yl]methanone?
The InChIKey is LRVQGFKSRFYBMY-QGZVFWFLSA-N. The full InChI is InChI=1S/C23H24N4O/c1-17(18-7-3-2-4-8-18)27-16-24-15-22(27)23(28)26-14-13-25(19-11-12-19)20-9-5-6-10-21(20)26/h2-10,15-17,19H,11-14H2,1H3/t17-/m1/s1.
What are the key properties of (4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[3-[(1R)-1-phenylethyl]imidazol-4-yl]methanone?
(4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[3-[(1R)-1-phenylethyl]imidazol-4-yl]methanone has a molecular weight of 372.47 g/mol, XLogP of 4.12, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[3-[(1R)-1-phenylethyl]imidazol-4-yl]methanone is sourced from PubChem (CID 155669602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).